Cas no 19653-55-5 (1-Azoniabicyclo[2.2.2]octane,1-[7-(1-methylpiperidinio)heptyl]-3-(phenylmethyl)-, bromide (1:2))

1-Azoniabicyclo[2.2.2]octane,1-[7-(1-methylpiperidinio)heptyl]-3-(phenylmethyl)-, bromide (1:2) structure
19653-55-5 structure
Product Name:1-Azoniabicyclo[2.2.2]octane,1-[7-(1-methylpiperidinio)heptyl]-3-(phenylmethyl)-, bromide (1:2)
CAS No:19653-55-5
MF:C27H46Br2N2
MW:558.475546360016
CID:185697
PubChem ID:209271
Update Time:2025-04-19

1-Azoniabicyclo[2.2.2]octane,1-[7-(1-methylpiperidinio)heptyl]-3-(phenylmethyl)-, bromide (1:2) Chemical and Physical Properties

Names and Identifiers

    • 1-Azoniabicyclo[2.2.2]octane,1-[7-(1-methylpiperidinio)heptyl]-3-(phenylmethyl)-, bromide (1:2)
    • 3-benzyl-1-[7-(1-methylpiperidin-1-ium-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane,dibromide
    • 8-benzyl-1-[7-(1-methyl-3,4,5,6-tetrahydro-2H-pyridin-1-yl)heptyl]-1-a zoniabicyclo[2.2.2]octane dibromide
    • 3-Benzyl-1-(7-(1-methylpiperidinio)heptyl)quinuclidinium, dibromide
    • 3-benzyl-1-[7-(1-methylpiperidinium-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane dibromide
    • Quinuclidinium, 3-benzyl-1-(7-(1-methylpiperidinio)heptyl)-, dibromide
    • 8-benzyl-1-[7-(1-methyl-3,4,5,6-tetrahydro-2H-pyridin-1-yl)heptyl]-1-a zoniabicyclo[2.2.2]octane dib
    • 3-BENZYL-1-[7-(1-METHYLPIPERIDIN-1-IUM-1-YL)HEPTYL]-1-AZABICYCLO[2.2.2]OCTAN-1-IUM DIBROMIDE
    • 3-benzyl-1-[7-(1-methylpiperidin-1-ium-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane;dibromide
    • DTXSID70941416
    • 19653-55-5
    • Inchi： 1S/C27H46N2.2BrH/c1-28(18-10-6-11-19-28)17-9-3-2-4-12-20-29-21-15-26(16-22-29)27(24-29)23-25-13-7-5-8-14-25;;/h5,7-8,13-14,26-27H,2-4,6,9-12,15-24H2,1H3;2*1H/q+2;;/p-2
    • InChI Key： XHYMGLOHGGOQMQ-UHFFFAOYSA-L
    • SMILES： [Br-].[Br-].[N+]12(CCCCCCC[N+]3(C)CCCCC3)CCC(CC1)C(CC1C=CC=CC=1)C2

Computed Properties

  • Exact Mass: 509.8428
  • Monoisotopic Mass: 556.202775
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 10
  • Complexity: 467
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 0

Experimental Properties

  • Density: g/cm3
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 0

1-Azoniabicyclo[2.2.2]octane,1-[7-(1-methylpiperidinio)heptyl]-3-(phenylmethyl)-, bromide (1:2) Related Literature

19653-55-5 (1-Azoniabicyclo[2.2.2]octane,1-[7-(1-methylpiperidinio)heptyl]-3-(phenylmethyl)-, bromide (1:2)) Related Products

Recommended suppliers
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hubei Cuiyuan Biotechnology Co.,Ltd
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Jiangsu Xinsu New Materials Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd
Zouping Mingyuan Import and Export Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Zouping Mingyuan Import and Export Trading Co., Ltd